==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 12-MAY-09 2KIX . COMPND 2 MOLECULE: BM2 PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: INFLUENZA B VIRUS . AUTHOR J.WANG,R.PIELAK,M.MCCLINTOCK,J.CHOU . 132 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10898.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 124 93.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 5 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 13.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 98 74.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A M 0 0 155 0, 0.0 2,-1.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 160.4 35.1 -20.7 -6.7 2 2 A L > + 0 0 109 1,-0.2 5,-0.6 0, 0.0 6,-0.1 -0.371 360.0 52.0 84.4 -60.9 37.5 -19.9 -3.8 3 3 A E T 5S+ 0 0 166 -2,-1.7 -1,-0.2 1,-0.2 0, 0.0 0.938 128.9 19.2 -74.5 -43.5 40.1 -18.1 -5.9 4 4 A P T 5S+ 0 0 66 0, 0.0 -1,-0.2 0, 0.0 0, 0.0 0.506 138.0 34.9-101.3 -9.2 37.6 -15.7 -7.6 5 5 A F T >>5S+ 0 0 82 2,-0.1 3,-2.8 3,-0.1 4,-1.7 0.785 112.6 48.0-110.8 -62.9 34.7 -16.0 -5.0 6 6 A Q H 3>5S+ 0 0 103 1,-0.3 4,-1.8 2,-0.2 5,-0.3 0.829 110.0 59.6 -52.9 -26.0 36.1 -16.5 -1.4 7 7 A I H 3> S+ 0 0 21 -3,-2.8 4,-2.5 2,-0.2 5,-0.3 0.926 109.1 47.6 -83.4 -48.9 35.2 -11.4 -2.9 9 9 A S H X S+ 0 0 22 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.964 119.6 39.8 -57.4 -51.5 33.4 -12.2 0.4 10 10 A I H X S+ 0 0 89 -4,-1.8 4,-2.2 -5,-0.2 3,-0.3 0.983 113.1 53.9 -64.0 -55.8 36.5 -11.6 2.5 11 11 A S H X S+ 0 0 52 -4,-1.3 4,-1.7 -5,-0.3 -1,-0.2 0.919 110.1 48.8 -43.0 -50.6 37.7 -8.5 0.5 12 12 A S H X S+ 0 0 36 -4,-2.5 4,-3.1 1,-0.2 -1,-0.3 0.923 105.4 58.3 -59.3 -41.2 34.3 -7.0 1.0 13 13 A F H X S+ 0 0 106 -4,-1.9 4,-1.9 -3,-0.3 5,-0.3 0.944 103.8 51.7 -55.4 -46.5 34.5 -7.7 4.8 14 14 A I H X S+ 0 0 111 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.919 112.3 46.5 -58.1 -40.8 37.7 -5.7 5.0 15 15 A L H X S+ 0 0 31 -4,-1.7 4,-3.3 -5,-0.3 5,-0.5 0.923 104.7 61.4 -68.9 -41.6 35.9 -2.8 3.3 16 16 A S H X S+ 0 0 44 -4,-3.1 4,-2.7 1,-0.2 -2,-0.2 0.951 108.9 41.6 -50.5 -52.5 32.8 -3.1 5.5 17 17 A A H X S+ 0 0 51 -4,-1.9 4,-1.9 2,-0.2 5,-0.3 0.886 114.4 54.0 -64.9 -34.9 34.8 -2.4 8.7 18 18 A L H X S+ 0 0 79 -4,-1.6 4,-2.5 -5,-0.3 5,-0.2 0.980 114.6 38.0 -63.9 -54.2 36.7 0.4 6.8 19 19 A H H X S+ 0 0 18 -4,-3.3 4,-2.1 1,-0.2 5,-0.2 0.897 109.6 64.2 -65.1 -37.1 33.5 2.2 5.7 20 20 A F H X S+ 0 0 107 -4,-2.7 4,-1.7 -5,-0.5 -1,-0.2 0.952 112.0 34.3 -52.2 -50.7 31.9 1.4 9.1 21 21 A I H X S+ 0 0 99 -4,-1.9 4,-2.3 1,-0.2 5,-0.2 0.942 114.9 56.2 -72.0 -45.6 34.5 3.6 10.9 22 22 A A H X S+ 0 0 10 -4,-2.5 4,-1.6 -5,-0.3 5,-0.3 0.787 108.5 52.2 -57.7 -22.4 34.9 6.1 8.1 23 23 A W H X S+ 0 0 48 -4,-2.1 4,-2.6 -5,-0.2 5,-0.5 0.929 106.8 48.5 -80.4 -47.1 31.1 6.6 8.5 24 24 A T H X S+ 0 0 73 -4,-1.7 4,-1.8 -5,-0.2 5,-0.3 0.875 117.6 44.1 -62.3 -33.6 31.1 7.2 12.2 25 25 A I H X S+ 0 0 101 -4,-2.3 4,-3.4 3,-0.2 5,-0.3 0.983 119.2 37.8 -75.7 -60.7 33.9 9.8 11.8 26 26 A G H X S+ 0 0 16 -4,-1.6 4,-1.2 -5,-0.2 -2,-0.2 0.882 123.9 45.0 -60.0 -34.4 32.6 11.7 8.7 27 27 A H H X S+ 0 0 85 -4,-2.6 4,-1.3 -5,-0.3 3,-0.2 0.970 118.3 40.2 -74.5 -52.2 29.1 11.4 10.1 28 28 A L H < S+ 0 0 98 -4,-1.8 -2,-0.2 -5,-0.5 -3,-0.2 0.924 110.7 60.0 -62.2 -41.1 29.8 12.4 13.7 29 29 A N H >X S+ 0 0 52 -4,-3.4 4,-1.8 -5,-0.3 3,-1.0 0.909 98.0 60.0 -54.5 -39.8 32.3 15.0 12.4 30 30 A Q H 3< S+ 0 0 158 -4,-1.2 2,-1.3 1,-0.3 -1,-0.2 0.961 107.9 43.6 -54.5 -51.2 29.4 16.7 10.6 31 31 A I T 3< S+ 0 0 141 -4,-1.3 -1,-0.3 -3,-0.2 -2,-0.1 -0.364 123.3 36.6 -91.3 58.7 27.5 17.2 13.9 32 32 A K T <4 0 0 141 -2,-1.3 -2,-0.2 -3,-1.0 -3,-0.2 0.101 360.0 360.0-165.2 -66.0 30.6 18.4 15.8 33 33 A R < 0 0 251 -4,-1.8 -2,-0.1 -5,-0.2 -3,-0.1 -0.281 360.0 360.0 50.8 360.0 33.0 20.6 13.9 34 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 35 1 B M 0 0 188 0, 0.0 5,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 140.7 31.5 -20.3 -12.8 36 2 B L - 0 0 98 1,-0.1 0, 0.0 2,-0.0 0, 0.0 0.296 360.0-156.3 -85.4-139.6 27.8 -19.8 -12.1 37 3 B E S > S+ 0 0 158 0, 0.0 4,-1.1 0, 0.0 -1,-0.1 0.147 73.9 44.4-166.4 -62.9 25.6 -17.5 -14.4 38 4 B P T 4 S+ 0 0 100 0, 0.0 4,-0.4 0, 0.0 3,-0.1 0.994 129.5 24.6 -62.1 -64.3 22.3 -16.0 -12.9 39 5 B F T >> S+ 0 0 65 1,-0.2 4,-1.8 2,-0.1 3,-0.5 0.679 109.7 82.4 -76.2 -15.3 23.7 -14.8 -9.5 40 6 B Q H >> S+ 0 0 48 1,-0.3 4,-1.8 2,-0.2 3,-0.9 0.982 89.2 46.7 -51.3 -69.8 27.2 -14.7 -11.0 41 7 B I H 3X S+ 0 0 112 -4,-1.1 4,-2.2 1,-0.3 -1,-0.3 0.747 107.0 63.7 -47.8 -22.0 26.9 -11.2 -12.6 42 8 B L H <> S+ 0 0 45 -3,-0.5 4,-1.9 -4,-0.4 -1,-0.3 0.966 102.2 45.5 -71.1 -49.3 25.4 -10.1 -9.3 43 9 B S H X S+ 0 0 72 -4,-1.8 4,-1.8 2,-0.2 3,-1.2 0.988 104.4 52.1 -60.5 -58.6 30.6 -9.0 -10.0 45 11 B S H 3X S+ 0 0 58 -4,-2.2 4,-1.9 1,-0.3 5,-0.2 0.908 107.4 54.1 -43.2 -48.0 28.5 -5.8 -10.0 46 12 B S H 3X S+ 0 0 43 -4,-1.9 4,-2.5 1,-0.2 -1,-0.3 0.890 102.9 57.6 -57.7 -35.5 29.1 -5.6 -6.2 47 13 B F H S+ 0 0 11 -4,-2.0 4,-3.2 -5,-0.5 5,-0.5 0.902 108.5 56.4 -63.2 -37.3 35.5 7.6 -4.3 57 23 B W H X5S+ 0 0 54 -4,-2.9 4,-2.2 1,-0.2 5,-0.3 0.942 105.2 50.6 -60.9 -44.9 35.9 7.7 -0.5 58 24 B T H X5S+ 0 0 76 -4,-1.8 4,-0.6 -5,-0.2 -1,-0.2 0.874 119.7 37.8 -62.5 -33.8 39.7 8.6 -0.9 59 25 B I H >X5S+ 0 0 87 -4,-1.6 3,-0.8 -5,-0.2 4,-0.7 0.959 120.9 40.7 -82.6 -58.3 38.7 11.4 -3.4 60 26 B G H >X5S+ 0 0 13 -4,-3.2 3,-1.1 1,-0.2 4,-0.8 0.866 105.4 67.6 -60.8 -33.4 35.5 12.8 -1.9 61 27 B H H >X S- 0 0 118 1,-0.1 4,-1.8 4,-0.0 5,-0.4 -0.123 91.4 -62.7 -78.9-172.6 14.4 -17.0 2.7 72 4 C P T 4 S+ 0 0 111 0, 0.0 -1,-0.1 0, 0.0 5,-0.0 0.491 135.1 63.4 -52.1 4.0 16.6 -14.3 4.5 73 5 C F T >> S+ 0 0 112 3,-0.1 4,-1.8 2,-0.1 3,-0.5 0.897 109.1 26.4 -96.4 -64.1 19.2 -15.3 1.8 74 6 C Q H 3> S+ 0 0 69 -3,-0.3 4,-1.9 1,-0.2 5,-0.2 0.875 120.1 57.8 -70.7 -32.2 17.8 -14.5 -1.7 75 7 C I H 3X S+ 0 0 80 -4,-1.8 4,-1.6 1,-0.2 -1,-0.2 0.748 106.8 51.7 -68.8 -18.1 15.6 -11.7 -0.3 76 8 C L H <> S+ 0 0 34 -3,-0.5 4,-2.9 -5,-0.4 5,-0.4 0.919 104.7 52.1 -83.5 -47.0 18.8 -10.1 1.1 77 9 C S H X S+ 0 0 18 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.929 114.6 44.9 -55.9 -42.8 20.8 -10.2 -2.2 78 10 C I H X S+ 0 0 66 -4,-1.9 4,-3.0 2,-0.2 5,-0.3 0.987 111.8 50.3 -66.7 -56.9 17.8 -8.4 -3.9 79 11 C S H X S+ 0 0 67 -4,-1.6 4,-1.6 1,-0.2 -2,-0.2 0.937 115.6 43.8 -44.7 -52.9 17.2 -5.8 -1.1 80 12 C S H X S+ 0 0 49 -4,-2.9 4,-3.1 1,-0.2 -1,-0.2 0.919 110.6 56.1 -61.7 -40.3 20.9 -5.0 -1.2 81 13 C F H X S+ 0 0 100 -4,-2.3 4,-1.8 -5,-0.4 5,-0.2 0.958 105.1 51.0 -57.9 -48.7 20.9 -5.0 -5.0 82 14 C I H X S+ 0 0 112 -4,-3.0 4,-1.8 1,-0.2 -1,-0.2 0.893 113.0 47.5 -57.2 -36.1 18.1 -2.3 -5.0 83 15 C L H X S+ 0 0 23 -4,-1.6 4,-3.2 -5,-0.3 5,-0.4 0.940 102.5 61.8 -71.8 -45.3 20.2 -0.3 -2.6 84 16 C S H X S+ 0 0 34 -4,-3.1 4,-2.0 1,-0.2 -2,-0.2 0.924 110.0 41.5 -46.9 -48.1 23.4 -0.7 -4.7 85 17 C A H X S+ 0 0 48 -4,-1.8 4,-2.5 2,-0.2 5,-0.3 0.959 112.6 53.4 -67.5 -48.0 21.7 1.1 -7.6 86 18 C L H X S+ 0 0 79 -4,-1.8 4,-2.3 -5,-0.2 5,-0.3 0.948 112.6 44.4 -52.2 -49.7 20.1 3.8 -5.4 87 19 C H H X S+ 0 0 19 -4,-3.2 4,-1.7 1,-0.2 -1,-0.2 0.910 109.2 57.8 -64.0 -39.3 23.5 4.6 -3.8 88 20 C F H X S+ 0 0 112 -4,-2.0 4,-1.6 -5,-0.4 -2,-0.2 0.966 113.0 38.5 -56.9 -51.9 25.2 4.7 -7.2 89 21 C I H >X S+ 0 0 103 -4,-2.5 4,-2.1 1,-0.2 3,-0.8 0.994 113.2 53.3 -63.6 -60.5 22.8 7.3 -8.6 90 22 C A H 3X S+ 0 0 10 -4,-2.3 4,-2.2 -5,-0.3 5,-0.4 0.812 108.3 56.0 -45.6 -28.0 22.6 9.4 -5.4 91 23 C W H 3X S+ 0 0 58 -4,-1.7 4,-2.2 -5,-0.3 5,-0.4 0.929 105.0 48.3 -73.6 -44.2 26.4 9.4 -5.6 92 24 C T H X S+ 0 0 66 -4,-2.2 4,-1.2 -5,-0.4 3,-0.9 0.941 109.4 51.7 -71.2 -43.6 28.9 14.2 -5.7 96 28 C L H 3< S+ 0 0 100 -4,-1.3 -2,-0.2 -5,-0.4 -1,-0.2 0.889 101.3 62.8 -59.9 -36.0 28.3 16.5 -8.7 97 29 C N H >< S+ 0 0 49 -4,-2.2 3,-0.9 1,-0.2 4,-0.4 0.867 97.5 58.8 -58.6 -32.2 26.7 19.0 -6.4 98 30 C Q H X< S+ 0 0 90 -3,-0.9 2,-1.3 -4,-0.8 3,-0.7 0.966 104.3 48.0 -63.2 -50.1 30.0 19.3 -4.6 99 31 C I T 3< S+ 0 0 139 -4,-1.2 -1,-0.3 1,-0.2 -2,-0.1 -0.201 89.4 95.8 -85.2 49.7 31.9 20.5 -7.8 100 32 C K T < 0 0 144 -2,-1.3 -1,-0.2 -3,-0.9 -2,-0.1 0.802 360.0 360.0-104.1 -45.1 29.1 23.0 -8.4 101 33 C R < 0 0 302 -3,-0.7 0, 0.0 -4,-0.4 0, 0.0 -0.391 360.0 360.0 -56.5 360.0 30.6 26.2 -6.9 102 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 103 1 D M 0 0 205 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 41.3 22.9 -21.2 9.1 104 2 D L - 0 0 112 1,-0.1 0, 0.0 2,-0.0 0, 0.0 0.417 360.0-136.1 -74.3-138.1 26.7 -21.5 8.8 105 3 D E S > S+ 0 0 160 3,-0.0 4,-1.2 0, 0.0 5,-0.1 0.326 88.0 38.5-148.9 -67.2 28.9 -19.5 11.2 106 4 D P T 4 S+ 0 0 105 0, 0.0 4,-0.1 0, 0.0 -2,-0.0 0.768 131.7 32.4 -66.4 -24.1 32.0 -17.7 9.7 107 5 D F T >> S+ 0 0 82 2,-0.1 3,-1.8 3,-0.1 4,-1.7 0.785 110.6 61.7-100.7 -38.1 29.9 -16.8 6.6 108 6 D Q H 3> S+ 0 0 60 1,-0.3 4,-2.0 2,-0.2 5,-0.3 0.815 98.6 61.0 -60.2 -25.4 26.5 -16.4 8.1 109 7 D I H 3X S+ 0 0 83 -4,-1.2 4,-1.7 2,-0.2 -1,-0.3 0.742 101.7 53.4 -74.0 -19.4 27.9 -13.6 10.2 110 8 D L H <> S+ 0 0 39 -3,-1.8 4,-2.4 2,-0.2 5,-0.2 0.938 108.6 46.5 -79.9 -48.5 28.7 -11.8 6.9 111 9 D S H X S+ 0 0 16 -4,-1.7 4,-1.4 2,-0.2 -2,-0.2 0.959 119.4 40.9 -58.7 -49.4 25.2 -12.0 5.5 112 10 D I H >X S+ 0 0 87 -4,-2.0 4,-1.9 1,-0.2 3,-0.7 0.974 113.0 53.4 -64.9 -52.3 23.7 -10.8 8.8 113 11 D S H 3X S+ 0 0 48 -4,-1.7 4,-1.8 1,-0.3 -1,-0.2 0.888 108.6 51.5 -48.8 -40.8 26.4 -8.1 9.4 114 12 D S H 3X S+ 0 0 35 -4,-2.4 4,-3.4 1,-0.2 -1,-0.3 0.864 103.6 58.3 -67.1 -32.6 25.6 -6.8 6.0 115 13 D F H S+ 0 0 35 -4,-2.9 4,-2.4 -5,-0.2 5,-0.5 0.933 109.3 51.2 -69.7 -43.7 21.7 8.2 3.6 126 24 D T H X5S+ 0 0 76 -4,-1.9 4,-1.2 -5,-0.3 -1,-0.2 0.858 116.7 42.2 -63.2 -31.9 18.1 9.5 3.7 127 25 D I H X5S+ 0 0 81 -4,-2.0 4,-2.7 2,-0.2 5,-0.3 0.972 120.8 36.5 -79.8 -60.4 19.1 11.8 6.7 128 26 D G H X5S+ 0 0 32 -4,-2.4 4,-1.6 -5,-0.2 -3,-0.2 0.897 121.2 49.2 -61.7 -36.7 22.5 13.1 5.5 129 27 D H H X5S+ 0 0 43 -4,-2.4 4,-1.4 -5,-0.4 -1,-0.2 0.975 112.3 46.5 -67.8 -50.7 21.2 13.3 1.9 130 28 D L H ><X S+ 0 0 68 -4,-2.7 4,-2.3 1,-0.2 3,-0.9 0.879 101.5 63.3 -59.9 -33.8 19.9 17.5 5.0 132 30 D Q H 3< S+ 0 0 78 -4,-1.6 2,-1.0 1,-0.3 -1,-0.2 0.916 100.3 52.7 -58.3 -40.3 22.3 18.2 2.1 133 31 D I T << S+ 0 0 111 -4,-1.4 -1,-0.3 -3,-0.6 -2,-0.1 -0.268 118.9 34.1 -90.8 51.8 19.4 19.6 0.1 134 32 D K T <4 0 0 139 -2,-1.0 -2,-0.2 -3,-0.9 -1,-0.1 0.193 360.0 360.0-162.8 -56.7 18.4 22.1 2.8 135 33 D R < 0 0 260 -4,-2.3 -3,-0.2 0, 0.0 -2,-0.1 0.941 360.0 360.0 -79.3 360.0 21.4 23.4 4.8